Exploring chemistry with electronic structure methods / James B. Foresman, Ãýleen Frisch.
Publisher: Wallingford, CT : Gaussian, Inc., 2015Copyright date: ©2015Edition: Third editionDescription: xv, 531 pages : illustrations (chiefly color), portraits (some color) ; 25 cmContent type:- text
- still image
- unmediated
- volume
- 9781935522034
| Item type | Current library | Home library | Call number | Materials specified | Copy number | Status | Date due | Barcode | |
|---|---|---|---|---|---|---|---|---|---|
| AM | PERPUSTAKAAN TUN SERI LANANG | PERPUSTAKAAN TUN SERI LANANG KOLEKSI AM-P. TUN SERI LANANG (ARAS 5) | QD39.3.E46.F67 2015 (Browse shelf(Opens below)) | 1 | Available | 00002290571 |
PROF. MADYA CHM. DR. NURUL IZZATY BINTI HASSAN/Jabatan Sains Kimia/drizz@ukm.edu.my/3878/mq
Includes bibliographical references (pages 503-522) and index.
Using Computations in Chemical Research -- Getting Started with Calculations -- Geometry Optimizations -- Predicting Chemical Properties -- Modeling Chemistry in Solution -- Studying Reaction Mechanisms -- Predicting Spectra -- Modeling Excited States -- Advanced Modeling Techniques -- The Theoretical Background -- Molecule index.
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